Vitas-M small molecule compound

(12bS)-2-[2-(3-fluorophenyl)ethyl]-7-(2-methoxyphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL529762
SMILES COc1ccccc1C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1cccc(c1)F

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H28FN3O3 MW 497.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28FN3O3/c1-30-28-27(22-11-3-5-12-24(22)32-28)23(21-10-4-6-13-25(21)37-2)17-34(30)26(35)18-33(29(30)36)15-14-19-8-7-9-20(31)16-19/h3-13,16,23,32H,14-15,17-18H2,1-2H3/t23?,30-/m0/s1
InChIKey
XMPLKVJQKSQTNG-POYPGSECSA-N
Synonyms
956946-73-9
(12bS)2(2(3fluorophenyl)ethyl)7(2methoxyphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(3fluorophenethyl)7(2methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4(2(3fluorophenyl)ethyl)9(2methoxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403048
956946739
COc1ccccc1C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1cccc(c1)F
InChI=1SC30H28FN3O3c1302827(2211351224(22)3228)23(2110461325(21)372)1734(30)26(35)1833(29(30)36)15141987920(31)1619h313162332H14151718H212H3t23?30m0s1
MFCD06494973
ZINC000008789328
ZINC000012878980

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Available files

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